ethyl 2-ethyl-2-(2-oxidanylidene-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)butanoate

Systemtic Name: ethyl 2-ethyl-2-(2-oxidanylidene-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)butanoate Openeye Name: ethyl 2-ethyl-2-(2-oxo-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)butanoate CAS Name: 2-ethyl-2-(2-oxo-4-phenyl-8-pyrimido[2,1-b][1,3]benzothiazolyl)butanoic acid ethyl ester IUPAC Name: ethyl 2-ethyl-2-(2-oxo-4-phenylpyrimido[2,1-b][1,3]benzothiazol-8-yl)butanoate Traditional Name: 2-ethyl-2-(2-keto-4-phenyl-pyrimido[2,1-b][1,3]benzothiazol-8-yl)butyric acid ethyl ester Formula: C24H24N2O3S MolecularWeight: 420.52396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC2=C(C=C1)N3C(=CC(=O)N=C3S2)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCC(CC)(C1=CC2=C(C=C1)N3C(=CC(=O)N=C3S2)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C24H24N2O3S/c1-4-24(5-2,22(28)29-6-3)17-12-13-18-20(14-17)30-23-25-21(27)15-19(26(18)23)16-10-8-7-9-11-16/h7-15H,4-6H2,1-3H3